Products 1776948-12-9

CAS 1776948-12-9 is the registry number for hBChE-IN-1. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

1-[3-[[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methylsulfanyl]propylamino]-4-methylthioxanthen-9-one (CAS 1776948-12-9) is a chemical compound with the molecular formula C27H34N2OS2 and a molecular weight of 466.7 g/mol. IUPAC name: 1-[3-[[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methylsulfanyl]propylamino]-4-methylthioxanthen-9-one. InChIKey: RTSVPQGEMHVGDV-NZQKXSOJSA-N.

Identity
Molecular formulaC27H34N2OS2
Molecular weight466.7 g/mol
IUPAC name1-[3-[[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methylsulfanyl]propylamino]-4-methylthioxanthen-9-one
InChIKeyRTSVPQGEMHVGDV-NZQKXSOJSA-N
SMILESCC1=C2C(=C(C=C1)NCCCSC[C@@H]3CCCN4[C@@H]3CCCC4)C(=O)C5=CC=CC=C5S2

Computed by PubChem (NCBI)

Synonyms: hBChE-IN-1, orb1982597